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Title: Materials Data on CrNi2Hg by Materials Project

Abstract

CrNi2Hg crystallizes in the cubic F-43m space group. The structure is three-dimensional. Cr is bonded in a distorted body-centered cubic geometry to ten Ni and four equivalent Hg atoms. There are four shorter (2.65 Å) and six longer (3.06 Å) Cr–Ni bond lengths. All Cr–Hg bond lengths are 2.65 Å. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded in a 8-coordinate geometry to six equivalent Cr, four equivalent Ni, and four equivalent Hg atoms. All Ni–Ni bond lengths are 2.65 Å. All Ni–Hg bond lengths are 2.65 Å. In the second Ni site, Ni is bonded in a 4-coordinate geometry to four equivalent Cr, four equivalent Ni, and six equivalent Hg atoms. All Ni–Hg bond lengths are 3.06 Å. Hg is bonded in a distorted body-centered cubic geometry to four equivalent Cr and ten Ni atoms.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-631502
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
Research Org.:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; CrNi2Hg; Cr-Hg-Ni
OSTI Identifier:
1279191
DOI:
10.17188/1279191

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on CrNi2Hg by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1279191.
Persson, Kristin, & Project, Materials. Materials Data on CrNi2Hg by Materials Project. United States. doi:10.17188/1279191.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on CrNi2Hg by Materials Project". United States. doi:10.17188/1279191. https://www.osti.gov/servlets/purl/1279191. Pub date:Fri Jul 24 00:00:00 EDT 2020
@article{osti_1279191,
title = {Materials Data on CrNi2Hg by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {CrNi2Hg crystallizes in the cubic F-43m space group. The structure is three-dimensional. Cr is bonded in a distorted body-centered cubic geometry to ten Ni and four equivalent Hg atoms. There are four shorter (2.65 Å) and six longer (3.06 Å) Cr–Ni bond lengths. All Cr–Hg bond lengths are 2.65 Å. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded in a 8-coordinate geometry to six equivalent Cr, four equivalent Ni, and four equivalent Hg atoms. All Ni–Ni bond lengths are 2.65 Å. All Ni–Hg bond lengths are 2.65 Å. In the second Ni site, Ni is bonded in a 4-coordinate geometry to four equivalent Cr, four equivalent Ni, and six equivalent Hg atoms. All Ni–Hg bond lengths are 3.06 Å. Hg is bonded in a distorted body-centered cubic geometry to four equivalent Cr and ten Ni atoms.},
doi = {10.17188/1279191},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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